ChemSpider 2D Image | 3-Chloro-N-[2-(dimethylamino)ethyl]-4-{[8-methyl-9-(2-methylphenyl)-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-yl]amino}benzamide | C28H30ClN7O

3-Chloro-N-[2-(dimethylamino)ethyl]-4-{[8-methyl-9-(2-methylphenyl)-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-yl]amino}benzamide

  • Molecular FormulaC28H30ClN7O
  • Average mass516.037 Da
  • Monoisotopic mass515.220032 Da
  • ChemSpider ID58935985

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3-Chlor-N-[2-(dimethylamino)ethyl]-4-{[8-methyl-9-(2-methylphenyl)-6,8-dihydro-5H-pyrazolo[3,4-h]chinazolin-2-yl]amino}benzamid [German] [ACD/IUPAC Name]
3-Chloro-N-[2-(dimethylamino)ethyl]-4-{[8-methyl-9-(2-methylphenyl)-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-yl]amino}benzamide [ACD/IUPAC Name]
3-Chloro-N-[2-(diméthylamino)éthyl]-4-{[8-méthyl-9-(2-méthylphényl)-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-yl]amino}benzamide [French] [ACD/IUPAC Name]
Benzamide, 3-chloro-4-[[6,8-dihydro-8-methyl-9-(2-methylphenyl)-5H-pyrazolo[3,4-h]quinazolin-2-yl]amino]-N-[2-(dimethylamino)ethyl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.680
Molar Refractivity: 146.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 4.96
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 16.66
ACD/KOC (pH 5.5): 60.53
ACD/LogD (pH 7.4): 4.31
ACD/BCF (pH 7.4): 819.17
ACD/KOC (pH 7.4): 2976.54
Polar Surface Area: 88 Å2
Polarizability: 58.2±0.5 10-24cm3
Surface Tension: 50.0±7.0 dyne/cm
Molar Volume: 388.4±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement